Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.59 |
| ▸ | THRB | P10828 | 1/20 | 0.59 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.55 |
| ▸ | SMPD1 | P17405 | 5/20 | 0.54 |
| ▸ | MGLL | Q99685 | 1/20 | 0.51 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL109695 | 0.85 | KDM4E (0.59) | HPGD | |
| SCHEMBL14930509 | 0.83 | SMPD1 (0.67) | THRATHRBPLA2G4BSMPD1MGLL | |
| SCHEMBL9307505 | 0.83 | SMPD1 (0.67) | THRATHRBPLA2G4BSMPD1MGLL | |
| SCHEMBL5216700 | 0.83 | MGLL (0.62) | THRATHRBPLA2G4BSMPD1MGLL | |
| SCHEMBL20237259 | 0.82 | HDAC6 (0.66) | THRATHRBPLA2G4BSMPD1NPC1 | |
| SCHEMBL11237309 | 0.82 | THRA (0.64) | THRATHRBPLA2G4BSMPD1MGLL | |
| SCHEMBL25231900 | 0.82 | HDAC6 (0.66) | THRATHRBPLA2G4BSMPD1NPC1 | |
| SCHEMBL11222195 | 0.82 | HDAC6 (0.66) | THRATHRBPLA2G4BSMPD1NPC1 | |
| SCHEMBL11241665 | 0.82 | HDAC6 (0.66) | THRATHRBPLA2G4BSMPD1NPC1 | |
| SCHEMBL1025801 | 0.82 | HDAC6 (0.66) | THRATHRBPLA2G4BSMPD1NPC1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113683508-B | Vanillin ester environment-friendly plasticizer and preparation method thereof | 安徽大学 | 2022-08-16 | — | — | CN | disclosed |
| CN-113683508-A | Vanillin ester environment-friendly plasticizer and preparation method thereof | 安徽大学 | 2021-11-23 | — | — | CN | disclosed |